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Ligand

NameCHEMBL1257376
Molecular formulaC26H30FN3O2
IUPAC name2-[(4-fluorophenyl)methyl]-8-(1-propan-2-ylpiperidin-4-yl)oxy-3,4-dihydropyrazino[1,2-a]indol-1-one
Molecular weight435.543
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP4.5
Synonyms2-(4-Fluoro-benzyl)-8-(1-isopropyl-piperidin-4-yloxy)-3,4-dihydro-2H-pyrazino[1,2-a]indol-1-one
AQACZABFCRPMGE-UHFFFAOYSA-N
2-(4-fluorobenzyl)-8-(1-isopropylpiperidin-4-yloxy)-3,4-dihydropyrazino[1,2-a]indol-1(2H)-one
BDBM50327483
SCHEMBL2980351
Inchi KeyAQACZABFCRPMGE-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H30FN3O2/c1-18(2)28-11-9-22(10-12-28)32-23-7-8-24-20(15-23)16-25-26(31)29(13-14-30(24)25)17-19-3-5-21(27)6-4-19/h3-8,15-16,18,22H,9-14,17H2,1-2H3
PubChem CID16678616
ChEMBLCHEMBL1257376
IUPHARN/A
BindingDB50327483
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
11512Histamine H1 receptorP35367HRH1Homo sapiens (Human)487
11514Histamine H2 receptorP25021HRH2Homo sapiens (Human)359
11515Histamine H3 receptorQ9Y5N1HRH3Homo sapiens (Human)445
11513Histamine H4 receptorQ9H3N8HRH4Homo sapiens (Human)390

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